N-(3-chloro-4-methoxyphenyl)-2-(9-fluoro-3-oxo[1,2,4]triazolo[4,3-c]quinazolin-2(3H)-yl)acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-2-(9-fluoro-3-oxo[1,2,4]triazolo[4,3-c]quinazolin-2(3H)-yl)acetamide
N-(3-chloro-4-methoxyphenyl)-2-(9-fluoro-3-oxo[1,2,4]triazolo[4,3-c]quinazolin-2(3H)-yl)acetamide
Compound characteristics
| Compound ID: | F810-0333 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-(9-fluoro-3-oxo[1,2,4]triazolo[4,3-c]quinazolin-2(3H)-yl)acetamide |
| Molecular Weight: | 401.78 |
| Molecular Formula: | C18 H13 Cl F N5 O3 |
| Smiles: | COc1ccc(cc1[Cl])NC(CN1C(N2C=Nc3ccc(cc3C2=N1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8201 |
| logD: | 2.8199 |
| logSw: | -3.4598 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.467 |
| InChI Key: | SFAMSBYIOKNICQ-UHFFFAOYSA-N |